#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2efi s SER 2 N 0.00 4.61 -0.09 1.61 0.01 -1.26 -5.01 113.70 113.57 2efi s SER 2 Ca 0.00 1.64 -0.09 0.00 1.31 0.00 0.00 55.95 58.81 2efi s SER 2 Cb 0.00 -2.39 -0.07 0.00 0.21 0.00 0.00 66.02 63.77 2efi s SER 2 CO 0.00 -1.94 0.32 -1.28 0.41 0.00 0.00 173.24 170.75 2efi h SER 3 N -1.06 -0.12 0.00 2.44 0.87 -2.15 -3.50 113.55 110.02 2efi h SER 3 Ca -0.45 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 2efi h SER 3 Cb 1.24 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2efi h SER 3 CO 0.55 0.43 0.00 0.61 -0.53 0.00 0.00 176.83 177.88 2efi n GLY 4 N 1.33 4.17 3.11 5.77 0.00 -1.26 -5.15 105.19 113.17 2efi n GLY 4 Ca -0.03 -1.17 -0.19 0.00 0.00 0.00 0.00 46.02 44.63 2efi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2efi s SER 5 N 0.00 1.47 -0.25 1.61 0.01 -1.26 -5.13 113.70 110.15 2efi s SER 5 Ca 0.00 -0.42 -0.11 0.00 1.31 0.00 0.00 55.95 56.73 2efi s SER 5 Cb 0.00 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.09 2efi s SER 5 CO 0.00 0.02 0.17 -0.44 0.41 0.00 0.00 173.24 173.40 2efi s SER 6 N -1.04 6.09 -0.44 2.44 0.01 -1.26 -5.05 113.70 114.44 2efi s SER 6 Ca 0.01 0.08 -0.04 0.00 1.31 0.00 0.00 55.95 57.30 2efi s SER 6 Cb -0.07 -2.11 0.12 0.00 0.21 0.00 0.00 66.02 64.16 2efi s SER 6 CO 0.01 0.02 0.26 -0.83 0.41 0.00 0.00 173.24 173.11 2efi s GLY 7 N 1.30 2.05 -0.02 3.44 0.00 -1.26 -5.08 107.32 107.75 2efi s GLY 7 Ca 0.08 -2.61 -0.01 0.00 0.00 0.00 0.00 44.72 42.17 2efi s GLY 7 CO 0.07 1.05 0.11 -0.29 0.00 0.00 0.00 173.10 174.04 2efi s MET 8 N 1.07 3.18 0.36 2.90 0.00 -1.26 -5.09 119.30 120.45 2efi s MET 8 Ca 0.09 -0.42 -0.26 0.00 0.00 0.00 0.00 55.69 55.10 2efi s MET 8 Cb -0.23 -2.94 -0.09 0.00 0.00 0.00 0.00 34.83 31.57 2efi s MET 8 CO -0.03 0.67 1.06 0.00 0.00 0.00 0.00 175.02 176.71 2efi s ALA 9 N -1.20 3.19 0.83 4.11 0.00 -1.26 -5.03 121.76 122.40 2efi s ALA 9 Ca 0.23 0.75 -0.11 0.00 0.00 0.00 0.00 51.96 52.83 2efi s ALA 9 Cb -0.12 -3.28 0.09 0.00 0.00 0.00 0.00 23.12 19.81 2efi s ALA 9 CO 0.14 -0.17 1.09 -1.25 0.00 0.00 0.00 175.76 175.57 2efi s PRO 10 N -2.13 1.80 -0.52 0.00 0.04 -1.26 -5.00 135.00 127.93 2efi s PRO 10 Ca 0.53 1.01 0.05 0.00 0.04 0.00 0.00 61.00 62.63 2efi s PRO 10 Cb -0.25 -1.86 0.38 0.00 0.04 0.00 0.00 34.50 32.81 2efi s PRO 10 CO 0.31 -1.92 1.05 0.36 0.04 0.00 0.00 177.00 176.85 2efi n LYS 11 N -3.69 3.36 -3.43 4.56 2.85 -1.26 -4.88 118.16 115.67 2efi n LYS 11 Ca 0.08 -4.67 -0.23 0.00 -1.05 0.00 0.00 58.31 52.43 2efi n LYS 11 Cb 0.54 -2.25 0.07 0.00 -0.65 0.00 0.00 35.03 32.74 2efi n LYS 11 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 2efi n GLN 12 N -0.36 -7.10 -3.61 -1.58 -0.06 -1.26 -4.99 117.38 98.41 2efi n GLN 12 Ca 0.35 0.85 -0.16 0.00 -2.00 0.00 0.00 57.00 56.04 2efi n GLN 12 Cb 0.52 -5.83 -0.07 0.00 -4.06 0.00 0.00 30.24 20.80 2efi n GLN 12 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2efi s ASP 13 N -3.15 -0.46 0.63 1.69 1.01 -1.26 -5.14 116.67 109.99 2efi s ASP 13 Ca 0.51 0.42 -0.16 0.00 0.71 0.00 0.00 52.55 54.02 2efi s ASP 13 Cb -0.22 0.45 -0.02 0.00 1.01 0.00 0.00 42.92 44.14 2efi s ASP 13 CO 0.63 -0.57 1.12 -2.16 0.21 0.00 0.00 175.17 174.40 2efi s PRO 14 N -1.40 2.95 -0.09 8.23 0.04 -1.26 -4.94 135.00 138.53 2efi s PRO 14 Ca -0.11 1.45 -0.09 0.00 0.04 0.00 0.00 61.00 62.29 2efi s PRO 14 Cb -0.02 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 2efi s PRO 14 CO 0.06 -1.14 0.20 0.15 0.04 0.00 0.00 177.00 176.32 2efi s LYS 15 N -3.87 3.56 0.80 4.56 -0.14 -1.26 -4.99 119.74 118.40 2efi s LYS 15 Ca 0.69 -0.00 -0.11 0.00 -1.36 0.00 0.00 55.97 55.18 2efi s LYS 15 Cb -0.21 -3.20 0.07 0.00 -1.68 0.00 0.00 37.83 32.80 2efi s LYS 15 CO 0.37 0.75 1.09 -1.25 -0.76 0.00 0.00 175.35 175.56 2efi s PRO 16 N -1.01 2.07 -0.25 -1.68 0.04 -1.26 -5.02 135.00 127.88 2efi s PRO 16 Ca 0.17 1.11 -0.09 0.00 0.04 0.00 0.00 61.00 62.23 2efi s PRO 16 Cb -0.13 -1.88 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 2efi s PRO 16 CO 0.06 -1.76 -0.30 1.63 0.04 0.00 0.00 177.00 176.68 2efi n LYS 17 N -3.59 0.56 -2.09 4.56 5.02 -1.26 -5.00 118.16 116.36 2efi n LYS 17 Ca 0.09 0.21 -0.30 0.00 -2.02 0.00 0.00 58.31 56.29 2efi n LYS 17 Cb 0.53 -1.44 0.02 0.00 -0.02 0.00 0.00 35.03 34.13 2efi n LYS 17 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2efi s PHE 18 N -2.48 3.50 0.23 2.13 0.40 -1.26 -5.10 117.98 115.41 2efi s PHE 18 Ca -0.35 1.06 0.10 0.00 -0.60 0.00 0.00 56.93 57.14 2efi s PHE 18 Cb 0.12 -2.72 -0.05 0.00 0.51 0.00 0.00 43.02 40.89 2efi s PHE 18 CO 0.48 -0.73 -0.18 -0.65 0.70 0.00 0.00 175.22 174.84 2efi s GLN 19 N -5.11 1.48 0.08 0.44 -0.21 -1.26 -5.06 119.66 110.02 2efi s GLN 19 Ca 0.54 -1.63 -0.31 0.00 0.02 0.00 0.00 55.36 53.98 2efi s GLN 19 Cb -0.11 -1.48 -0.07 0.00 1.00 0.00 0.00 33.01 32.35 2efi s GLN 19 CO 0.51 0.28 1.40 -1.21 -2.12 0.00 0.00 175.29 174.14 2efi s GLU 20 N -3.37 4.31 0.00 2.91 2.02 -1.26 -2.52 118.70 120.79 2efi s GLU 20 Ca 0.24 2.05 0.00 0.00 0.02 0.00 0.00 54.97 57.28 2efi s GLU 20 Cb -0.04 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.84 2efi s GLU 20 CO 0.10 -0.48 0.00 0.41 0.02 0.00 0.00 175.26 175.32 2efi n GLY 21 N 3.54 0.52 3.67 -1.39 0.00 0.64 -4.99 105.19 107.19 2efi n GLY 21 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2efi n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2efi s GLU 22 N -0.98 4.25 0.28 1.61 2.12 -1.05 -4.86 118.70 120.07 2efi s GLU 22 Ca 0.00 0.60 -0.30 0.00 0.36 0.00 0.00 54.97 55.63 2efi s GLU 22 Cb 0.00 -3.54 -0.13 0.00 0.26 0.00 0.00 34.13 30.72 2efi s GLU 22 CO 0.00 -0.14 1.34 -2.13 -0.54 0.00 0.00 175.26 173.79 2efi n ARG 23 N 4.68 2.02 -3.66 4.30 0.63 -1.26 -2.93 116.66 120.44 2efi n ARG 23 Ca -0.03 0.72 -0.10 0.00 -0.92 0.00 0.00 57.85 57.52 2efi n ARG 23 Cb 0.50 -2.33 -0.05 0.00 0.45 0.00 0.00 32.46 31.04 2efi n ARG 23 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2efi s VAL 24 N -0.50 0.08 -0.23 5.15 -7.23 -0.25 -4.38 120.40 113.04 2efi s VAL 24 Ca 0.63 -0.63 -0.07 0.00 -1.81 0.00 0.00 61.98 60.10 2efi s VAL 24 Cb -0.62 -1.16 -0.03 0.00 0.56 0.00 0.00 36.38 35.13 2efi s VAL 24 CO 0.55 -0.35 0.05 -0.76 -0.31 0.00 0.00 175.10 174.28 2efi s LEU 25 N -2.73 3.40 -0.04 1.32 1.43 -1.24 -2.33 118.68 118.48 2efi s LEU 25 Ca 0.02 -0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 52.88 2efi s LEU 25 Cb 0.02 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 2efi s LEU 25 CO -0.11 0.00 0.20 0.00 0.23 0.00 0.00 176.35 176.67 2efi s PHE 27 N -1.21 2.91 -0.36 0.00 0.08 -0.95 -2.99 117.98 115.46 2efi s PHE 27 Ca 0.23 -0.08 0.06 0.00 0.12 0.00 0.00 56.93 57.26 2efi s PHE 27 Cb -0.13 -3.82 0.49 0.00 -0.57 0.00 0.00 43.02 38.98 2efi s PHE 27 CO 0.13 -1.17 1.49 1.58 -0.10 0.00 0.00 175.22 177.15 2efi n HIS 28 N 6.95 1.98 0.00 0.36 -0.00 -1.23 -5.05 115.22 118.23 2efi n HIS 28 Ca 0.00 -2.05 0.00 0.00 -0.00 0.00 0.00 57.72 55.67 2efi n HIS 28 Cb 0.47 -0.62 0.00 0.00 -0.00 0.00 0.00 29.99 29.84 2efi n HIS 28 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2efi n GLY 29 N -0.97 0.46 0.00 1.57 0.00 -1.26 -4.72 105.19 100.28 2efi n GLY 29 Ca 0.42 -1.93 0.05 0.00 0.00 0.00 0.00 46.02 44.56 2efi n GLY 29 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2efi n PRO 30 N 0.00 0.49 -4.01 1.61 -0.04 -1.26 -4.70 135.00 127.09 2efi n PRO 30 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 2efi n PRO 30 Cb 0.00 -1.33 -0.11 0.00 -0.04 0.00 0.00 33.50 32.02 2efi n PRO 30 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2efi s LEU 31 N -1.66 2.28 -0.07 1.53 1.43 -1.26 -4.89 118.68 116.04 2efi s LEU 31 Ca 0.16 -0.65 -0.06 0.00 -1.03 0.00 0.00 54.13 52.55 2efi s LEU 31 Cb 0.07 0.17 -0.04 0.00 0.03 0.00 0.00 46.19 46.42 2efi s LEU 31 CO 0.12 -0.40 0.18 -0.76 0.23 0.00 0.00 176.35 175.71 2efi s LEU 32 N -1.94 4.38 0.10 1.79 1.43 -1.26 -3.47 118.68 119.71 2efi s LEU 32 Ca -0.08 0.45 0.09 0.00 -1.03 0.00 0.00 54.13 53.56 2efi s LEU 32 Cb -0.04 -2.33 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 2efi s LEU 32 CO -0.04 0.34 -0.24 -0.31 0.23 0.00 0.00 176.35 176.33 2efi s TYR 33 N -1.16 2.10 0.19 0.29 1.51 -1.16 -4.88 117.35 114.25 2efi s TYR 33 Ca 0.21 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.57 2efi s TYR 33 Cb -0.12 -1.18 -0.09 0.00 -0.11 0.00 0.00 41.96 40.46 2efi s TYR 33 CO 0.10 0.23 1.31 -2.00 -1.11 0.00 0.00 175.55 174.09 2efi s GLU 34 N -1.75 4.38 0.28 -0.62 2.12 -1.26 -3.11 118.70 118.74 2efi s GLU 34 Ca 0.11 2.05 -0.21 0.00 0.36 0.00 0.00 54.97 57.28 2efi s GLU 34 Cb -0.10 -3.20 0.03 0.00 0.26 0.00 0.00 34.13 31.12 2efi s GLU 34 CO 0.04 -0.26 0.75 0.00 -0.54 0.00 0.00 175.26 175.25 2efi s ALA 35 N 0.17 -1.20 0.01 6.30 0.00 -0.98 -2.84 121.76 123.22 2efi s ALA 35 Ca 0.57 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.21 2efi s ALA 35 Cb -0.36 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.55 2efi s ALA 35 CO 0.38 -1.03 -0.04 0.21 0.00 0.00 0.00 175.76 175.28 2efi s LYS 36 N -3.65 0.29 -0.38 0.00 2.36 -1.25 -1.09 119.74 116.02 2efi s LYS 36 Ca 0.12 -0.39 -0.27 0.00 -2.55 0.00 0.00 55.97 52.88 2efi s LYS 36 Cb -0.05 -0.10 -0.04 0.00 -1.05 0.00 0.00 37.83 36.58 2efi s LYS 36 CO 0.07 0.01 2.12 0.00 1.55 0.00 0.00 175.35 179.11 2efi h VAL 38 N 7.19 1.14 -3.74 0.00 2.07 -0.19 0.18 116.25 122.90 2efi h VAL 38 Ca -0.32 -2.54 -0.08 0.00 0.82 0.00 0.00 66.70 64.58 2efi h VAL 38 Cb 1.22 2.90 -0.11 0.00 -1.52 0.00 0.00 31.29 33.77 2efi h VAL 38 CO 1.07 0.79 -0.22 -0.54 0.02 0.00 0.00 177.57 178.69 2efi s LYS 39 N -2.53 1.28 -0.18 1.57 1.02 -1.10 -4.81 119.74 114.98 2efi s LYS 39 Ca -0.15 -1.14 -0.03 0.00 0.02 0.00 0.00 55.97 54.68 2efi s LYS 39 Cb 0.04 0.42 0.06 0.00 -0.52 0.00 0.00 37.83 37.83 2efi s LYS 39 CO 0.85 -0.50 0.03 0.08 -0.92 0.00 0.00 175.35 174.90 2efi s VAL 40 N -3.96 0.52 0.29 3.17 1.01 -1.26 -0.42 120.40 119.74 2efi s VAL 40 Ca 0.17 -0.50 0.11 0.00 0.00 0.00 0.00 61.98 61.76 2efi s VAL 40 Cb 0.02 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 2efi s VAL 40 CO 0.01 -0.16 -0.17 0.00 0.00 0.00 0.00 175.10 174.78 2efi s ALA 41 N 1.86 2.73 -0.10 5.51 0.00 -0.73 -5.01 121.76 126.02 2efi s ALA 41 Ca -0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 51.96 50.02 2efi s ALA 41 Cb -0.17 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.81 2efi s ALA 41 CO -0.08 0.21 0.06 0.42 0.00 0.00 0.00 175.76 176.37 2efi s ILE 42 N -2.58 0.05 0.30 0.00 1.01 -1.26 -0.55 121.20 118.17 2efi s ILE 42 Ca 0.30 0.11 -0.08 0.00 0.00 0.00 0.00 60.65 60.98 2efi s ILE 42 Cb -0.03 -0.43 0.00 0.00 0.01 0.00 0.00 42.46 42.02 2efi s ILE 42 CO 0.15 0.03 0.49 -1.59 0.00 0.00 0.00 174.94 174.02 2efi s LYS 43 N 2.09 1.76 -0.96 2.79 -2.85 -0.32 -4.90 119.74 117.35 2efi s LYS 43 Ca 0.04 -1.50 -0.08 0.00 -1.00 0.00 0.00 55.97 53.42 2efi s LYS 43 Cb -0.14 0.47 0.08 0.00 -2.06 0.00 0.00 37.83 36.18 2efi s LYS 43 CO -0.06 -0.74 0.30 -0.25 0.10 0.00 0.00 175.35 174.70 2efi n ASP 44 N -0.92 -2.40 -3.50 0.03 9.92 -1.26 0.11 116.55 118.53 2efi n ASP 44 Ca -0.01 -0.21 -0.24 0.00 -0.53 0.00 0.00 54.79 53.79 2efi n ASP 44 Cb 0.62 -2.07 0.06 0.00 -0.64 0.00 0.00 41.12 39.08 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2efi n LYS 45 N -3.29 -6.83 -3.75 -1.24 4.76 -1.26 -4.99 118.16 101.57 2efi n LYS 45 Ca 0.01 0.81 -0.14 0.00 -2.87 0.00 0.00 58.31 56.12 2efi n LYS 45 Cb 0.51 -5.79 -0.08 0.00 -1.84 0.00 0.00 35.03 27.83 2efi n LYS 45 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2efi s GLN 46 N -6.21 0.69 -0.22 1.97 -2.07 0.30 -5.06 119.66 109.06 2efi s GLN 46 Ca 0.53 -0.16 -0.11 0.00 -1.82 0.00 0.00 55.36 53.80 2efi s GLN 46 Cb -0.24 0.31 -0.05 0.00 -1.09 0.00 0.00 33.01 31.94 2efi s GLN 46 CO 0.65 -0.19 0.16 0.08 -1.32 0.00 0.00 175.29 174.67 2efi s VAL 47 N -1.30 5.38 0.33 3.63 1.01 -1.26 -1.18 120.40 127.00 2efi s VAL 47 Ca -0.13 0.21 0.08 0.00 0.00 0.00 0.00 61.98 62.14 2efi s VAL 47 Cb -0.05 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.77 2efi s VAL 47 CO 0.05 0.39 -0.05 -0.54 0.00 0.00 0.00 175.10 174.94 2efi s LYS 48 N 0.73 1.72 -0.10 2.72 1.02 0.29 -2.29 119.74 123.84 2efi s LYS 48 Ca 0.08 -1.90 -0.04 0.00 0.02 0.00 0.00 55.97 54.14 2efi s LYS 48 Cb -0.12 -1.42 0.05 0.00 -0.52 0.00 0.00 37.83 35.82 2efi s LYS 48 CO 0.02 0.05 0.18 0.71 -0.92 0.00 0.00 175.35 175.39 2efi s TYR 49 N -2.83 -0.22 -0.49 3.18 1.51 0.17 -1.78 117.35 116.89 2efi s TYR 49 Ca 0.32 0.64 -0.26 0.00 -1.01 0.00 0.00 57.07 56.76 2efi s TYR 49 Cb 0.04 -0.23 -0.06 0.00 -0.11 0.00 0.00 41.96 41.61 2efi s TYR 49 CO 0.15 -0.31 2.25 0.12 -1.11 0.00 0.00 175.55 176.65 2efi s PHE 50 N 2.32 1.23 0.50 2.71 5.36 0.44 -2.56 117.98 127.97 2efi s PHE 50 Ca 0.03 1.29 -0.15 0.00 -0.96 0.00 0.00 56.93 57.13 2efi s PHE 50 Cb -0.12 -3.74 -0.07 0.00 -0.34 0.00 0.00 43.02 38.75 2efi s PHE 50 CO -0.07 -2.63 0.95 0.42 -1.46 0.00 0.00 175.22 172.44 2efi s ILE 51 N 11.04 4.59 -0.41 3.12 -1.09 -1.13 0.58 121.20 137.89 2efi s ILE 51 Ca 0.91 1.09 0.02 0.00 -2.23 0.00 0.00 60.65 60.44 2efi s ILE 51 Cb -0.18 -3.73 0.13 0.00 -1.58 0.00 0.00 42.46 37.10 2efi s ILE 51 CO 0.26 -0.68 0.20 -2.28 -1.23 0.00 0.00 174.94 171.21 2efi s HIS 52 N -2.61 2.06 -0.56 3.97 5.65 -1.15 -4.25 115.29 118.40 2efi s HIS 52 Ca 0.57 -2.35 -0.30 0.00 0.25 0.00 0.00 55.06 53.23 2efi s HIS 52 Cb -0.10 -1.94 -0.12 0.00 -1.18 0.00 0.00 32.58 29.24 2efi s HIS 52 CO 0.32 -0.81 2.42 0.66 -0.65 0.00 0.00 174.74 176.68 2efi n TYR 53 N 3.80 1.30 -1.05 3.88 4.01 -1.26 -3.90 117.16 123.93 2efi n TYR 53 Ca 0.06 0.20 -0.39 0.00 -0.16 0.00 0.00 57.90 57.62 2efi n TYR 53 Cb 0.36 -2.56 -0.04 0.00 -0.31 0.00 0.00 39.34 36.79 2efi n TYR 53 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2efi n SER 54 N 12.88 -0.43 0.00 7.72 2.88 -1.13 -4.72 113.62 130.81 2efi n SER 54 Ca 0.45 0.83 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 2efi n SER 54 Cb 0.34 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2efi n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2efi n GLY 55 N 1.26 -0.15 0.56 0.46 0.00 -1.26 -5.01 105.19 101.05 2efi n GLY 55 Ca 0.14 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.17 2efi n GLY 55 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2efi n TRP 56 N 5.26 0.00 -2.49 1.61 8.01 -1.26 -4.99 117.44 123.58 2efi n TRP 56 Ca 0.00 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.77 2efi n TRP 56 Cb 0.00 -0.39 -0.03 0.00 -2.01 0.00 0.00 31.31 28.87 2efi n TRP 56 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.69 175.88 2efi s ASN 57 N -6.13 7.18 -0.20 -0.99 0.01 -1.26 -4.94 114.94 108.60 2efi s ASN 57 Ca -0.18 1.98 0.14 0.00 -0.71 0.00 0.00 52.86 54.10 2efi s ASN 57 Cb 0.05 -2.58 0.45 0.00 0.41 0.00 0.00 41.25 39.57 2efi s ASN 57 CO 0.24 -0.37 1.19 2.29 -1.51 0.00 0.00 177.10 178.94 2efi n LYS 58 N 3.47 1.90 -0.01 -0.60 0.00 -1.26 -4.69 118.16 116.98 2efi n LYS 58 Ca 0.07 -3.35 0.08 0.00 -0.00 0.00 0.00 58.31 55.11 2efi n LYS 58 Cb 0.47 -1.51 -0.12 0.00 -0.00 0.00 0.00 35.03 33.87 2efi n LYS 58 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2efi n ASN 59 N -0.64 1.38 -1.62 -5.58 4.13 -1.26 -4.37 115.26 107.30 2efi n ASN 59 Ca 0.22 -0.08 0.03 0.00 1.68 0.00 0.00 54.58 56.44 2efi n ASN 59 Cb 0.87 1.64 0.30 0.00 -1.54 0.00 0.00 39.78 41.05 2efi n ASN 59 CO 0.00 0.00 0.00 -2.67 0.28 0.00 0.00 177.26 174.87 2efi n TRP 60 N -1.98 1.69 -1.16 3.10 4.27 -1.26 -4.95 117.44 117.16 2efi n TRP 60 Ca -0.02 -0.64 -0.22 0.00 -3.89 0.00 0.00 57.50 52.72 2efi n TRP 60 Cb 0.39 -0.45 0.18 0.00 -1.36 0.00 0.00 31.31 30.06 2efi n TRP 60 CO 0.00 0.00 0.00 -0.25 -2.29 0.00 0.00 177.69 175.15 2efi n ASP 61 N 0.39 -1.22 -3.57 -0.67 8.00 -1.26 -5.03 116.55 113.18 2efi n ASP 61 Ca 0.24 -1.11 -0.07 0.00 0.71 0.00 0.00 54.79 54.56 2efi n ASP 61 Cb 1.03 -0.75 -0.02 0.00 -0.02 0.00 0.00 41.12 41.35 2efi n ASP 61 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2efi s GLU 62 N -4.96 0.86 -0.16 -1.24 1.03 -1.26 -5.09 118.70 107.88 2efi s GLU 62 Ca 0.54 -0.37 -0.18 0.00 0.03 0.00 0.00 54.97 54.99 2efi s GLU 62 Cb -0.04 0.36 -0.04 0.00 -0.80 0.00 0.00 34.13 33.61 2efi s GLU 62 CO 0.40 -0.38 0.47 -1.58 -1.33 0.00 0.00 175.26 172.84 2efi s TRP 63 N -3.09 3.44 0.10 4.83 0.52 -1.26 -2.84 118.94 120.63 2efi s TRP 63 Ca 0.07 0.80 0.08 0.00 0.02 0.00 0.00 56.10 57.07 2efi s TRP 63 Cb -0.01 -2.58 -0.04 0.00 -1.15 0.00 0.00 33.47 29.69 2efi s TRP 63 CO -0.06 0.05 -0.14 0.14 0.02 0.00 0.00 176.95 176.96 2efi s VAL 64 N 1.08 3.11 0.89 4.03 -7.23 -1.06 -4.87 120.40 116.34 2efi s VAL 64 Ca 0.24 -1.32 -0.15 0.00 -1.81 0.00 0.00 61.98 58.94 2efi s VAL 64 Cb -0.15 -2.42 0.22 0.00 0.56 0.00 0.00 36.38 34.59 2efi s VAL 64 CO 0.09 0.15 0.79 -0.81 -0.31 0.00 0.00 175.10 175.01 2efi n PRO 65 N 0.89 -2.56 0.15 4.82 -0.04 -1.26 0.46 135.00 137.47 2efi n PRO 65 Ca -0.15 -1.26 0.13 0.00 -0.04 0.00 0.00 63.50 62.18 2efi n PRO 65 Cb 0.52 -1.18 0.30 0.00 -0.04 0.00 0.00 33.50 33.10 2efi n PRO 65 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2efi h GLU 66 N 0.00 0.00 0.00 0.54 4.81 -1.83 -3.18 114.58 114.93 2efi h GLU 66 Ca -0.30 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.87 2efi h GLU 66 Cb 0.91 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 2efi h GLU 66 CO 0.19 0.00 -0.81 1.03 -0.73 0.00 0.00 179.01 178.69 2efi h SER 67 N 0.00 0.00 -0.39 1.04 0.87 -1.92 -3.27 113.55 109.88 2efi h SER 67 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2efi h SER 67 Cb 0.85 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2efi h SER 67 CO 0.00 0.26 0.00 0.54 -0.53 0.00 0.00 176.83 177.10 2efi n ARG 68 N -2.93 3.25 -4.56 2.24 1.74 -1.20 -4.85 116.66 110.35 2efi n ARG 68 Ca -0.01 -1.97 -0.22 0.00 -0.77 0.00 0.00 57.85 54.87 2efi n ARG 68 Cb 0.66 -1.88 -0.16 0.00 -1.02 0.00 0.00 32.46 30.07 2efi n ARG 68 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2efi s VAL 69 N -1.99 1.03 0.35 1.55 1.01 -1.24 -2.23 120.40 118.89 2efi s VAL 69 Ca 0.35 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.91 2efi s VAL 69 Cb 0.25 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2efi s VAL 69 CO 0.12 0.31 0.22 -0.76 0.00 0.00 0.00 175.10 174.99 2efi s LEU 70 N 0.13 3.37 -0.00 3.92 1.43 -0.74 -4.93 118.68 121.86 2efi s LEU 70 Ca -0.03 -0.70 0.05 0.00 -1.03 0.00 0.00 54.13 52.41 2efi s LEU 70 Cb -0.10 -1.90 0.14 0.00 0.03 0.00 0.00 46.19 44.37 2efi s LEU 70 CO 0.01 -0.37 1.10 0.29 0.23 0.00 0.00 176.35 177.61 2efi n LYS 71 N -1.27 1.40 -4.12 1.70 4.01 -1.26 -3.64 118.16 114.98 2efi n LYS 71 Ca -0.02 -0.58 -0.31 0.00 -0.51 0.00 0.00 58.31 56.89 2efi n LYS 71 Cb 0.61 -1.15 -0.03 0.00 -0.51 0.00 0.00 35.03 33.94 2efi n LYS 71 CO 0.00 0.00 0.00 0.98 -1.11 0.00 0.00 177.40 177.27 2efi n TYR 72 N -0.02 -1.65 -3.97 2.13 4.19 -1.26 -4.91 117.16 111.66 2efi n TYR 72 Ca 0.05 0.76 -0.22 0.00 3.31 0.00 0.00 57.90 61.80 2efi n TYR 72 Cb 0.15 -3.28 -0.05 0.00 0.49 0.00 0.00 39.34 36.65 2efi n TYR 72 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2efi s VAL 73 N -3.69 3.59 0.13 2.97 -7.23 -1.26 -4.88 120.40 110.03 2efi s VAL 73 Ca 0.35 -1.49 -0.20 0.00 -1.81 0.00 0.00 61.98 58.83 2efi s VAL 73 Cb -0.19 -3.16 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2efi s VAL 73 CO 0.92 -0.22 1.12 0.47 -0.31 0.00 0.00 175.10 177.07 2efi n ASP 74 N -1.25 -0.70 -0.02 4.85 8.00 -1.26 0.43 116.55 126.60 2efi n ASP 74 Ca -0.04 1.28 -0.10 0.00 0.71 0.00 0.00 54.79 56.64 2efi n ASP 74 Cb 0.60 -0.19 -0.04 0.00 -0.02 0.00 0.00 41.12 41.46 2efi n ASP 74 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2efi h THR 75 N 0.00 0.24 -0.02 -3.53 2.02 -2.00 0.16 112.91 109.78 2efi h THR 75 Ca 0.15 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.33 2efi h THR 75 Cb 0.33 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2efi h THR 75 CO -0.69 0.00 0.02 0.78 0.37 0.00 0.00 175.52 176.00 2efi h ASN 76 N -0.40 0.00 -0.10 4.18 2.35 -0.57 -1.72 115.58 119.32 2efi h ASN 76 Ca 0.10 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.66 2efi h ASN 76 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 2efi h ASN 76 CO -0.39 0.00 -0.66 -0.07 -1.65 0.00 0.00 177.43 174.66 2efi h LEU 77 N 0.00 0.83 -1.98 1.61 3.38 0.23 -2.71 115.31 116.68 2efi h LEU 77 Ca 0.01 -0.50 0.19 0.00 0.09 0.00 0.00 57.88 57.68 2efi h LEU 77 Cb 0.05 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2efi h LEU 77 CO -0.00 1.27 0.54 1.56 0.09 0.00 0.00 178.44 181.90 2efi h GLN 78 N 0.52 0.00 0.00 1.13 4.20 0.16 -1.97 115.11 119.16 2efi h GLN 78 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2efi h GLN 78 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 2efi h GLN 78 CO 0.13 0.00 -0.20 -0.22 -0.67 0.00 0.00 178.83 177.87 2efi h LYS 79 N 0.00 0.00 -1.40 1.46 3.64 -1.56 -2.94 116.57 115.77 2efi h LYS 79 Ca 0.32 0.00 0.44 0.00 -1.27 0.00 0.00 60.65 60.13 2efi h LYS 79 Cb 1.39 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.12 2efi h LYS 79 CO -0.00 0.00 0.96 0.94 -2.27 0.00 0.00 179.45 179.08 2efi n GLN 80 N -3.50 -0.01 0.01 1.90 7.27 -1.03 0.18 117.38 122.20 2efi n GLN 80 Ca -0.03 0.96 -0.20 0.00 0.07 0.00 0.00 57.00 57.79 2efi n GLN 80 Cb 0.10 -2.05 -0.14 0.00 2.41 0.00 0.00 30.24 30.57 2efi n GLN 80 CO 0.00 0.00 0.00 0.07 0.07 0.00 0.00 177.06 177.20 2efi h ARG 81 N 0.00 0.23 -0.74 3.69 0.11 -1.52 -2.68 114.38 113.47 2efi h ARG 81 Ca 0.75 -0.39 0.10 0.00 0.10 0.00 0.00 59.98 60.54 2efi h ARG 81 Cb 2.74 0.15 -0.05 0.00 1.11 0.00 0.00 29.97 33.92 2efi h ARG 81 CO -0.19 1.19 0.48 1.05 0.10 0.00 0.00 179.97 182.61 2efi h GLU 82 N -0.42 0.60 0.10 0.08 4.11 0.21 0.16 114.58 119.43 2efi h GLU 82 Ca -0.23 -0.04 -0.15 0.00 0.07 0.00 0.00 59.36 59.01 2efi h GLU 82 Cb 1.64 -0.14 0.02 0.00 0.50 0.00 0.00 28.75 30.77 2efi h GLU 82 CO 0.07 0.40 -0.66 -0.07 0.07 0.00 0.00 179.01 178.81 2efi h LEU 83 N 0.62 0.42 -1.97 3.06 3.38 -1.11 0.17 115.31 119.88 2efi h LEU 83 Ca 0.34 -0.92 -0.02 0.00 0.09 0.00 0.00 57.88 57.38 2efi h LEU 83 Cb 0.49 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2efi h LEU 83 CO -0.12 1.30 -0.08 1.56 0.09 0.00 0.00 178.44 181.18 2efi h GLN 84 N -0.40 0.00 0.00 1.13 4.20 -1.07 -2.15 115.11 116.83 2efi h GLN 84 Ca -0.11 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.40 2efi h GLN 84 Cb 1.49 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.23 2efi h GLN 84 CO 0.13 0.08 -1.74 0.36 -0.67 0.00 0.00 178.83 176.99 2efi n LYS 85 N -4.14 0.64 -0.10 1.46 2.85 0.52 -4.08 118.16 115.32 2efi n LYS 85 Ca -0.03 0.12 -0.10 0.00 -1.05 0.00 0.00 58.31 57.26 2efi n LYS 85 Cb 0.17 -1.70 -0.02 0.00 -0.65 0.00 0.00 35.03 32.82 2efi n LYS 85 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2efi h ALA 86 N 1.36 0.39 -3.02 0.58 0.00 -0.32 -3.37 119.26 114.89 2efi h ALA 86 Ca -0.24 -0.13 -0.62 0.00 0.00 0.00 0.00 54.91 53.93 2efi h ALA 86 Cb 1.70 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.97 2efi h ALA 86 CO 0.04 -0.00 -0.71 -0.80 0.00 0.00 0.00 179.25 177.77 2efi s ASN 87 N -5.74 3.75 0.06 0.00 0.01 -0.95 -4.97 114.94 107.09 2efi s ASN 87 Ca -0.13 -2.91 -0.22 0.00 -0.71 0.00 0.00 52.86 48.89 2efi s ASN 87 Cb 0.09 -1.18 -0.13 0.00 0.41 0.00 0.00 41.25 40.44 2efi s ASN 87 CO 0.73 -0.23 1.50 1.56 -1.51 0.00 0.00 177.10 179.16 2efi h GLN 88 N 6.40 0.20 -0.96 -0.60 4.20 -1.74 -2.28 115.11 120.33 2efi h GLN 88 Ca 0.02 -0.06 0.06 0.00 0.06 0.00 0.00 58.65 58.73 2efi h GLN 88 Cb 0.89 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.59 2efi h GLN 88 CO 0.54 0.42 0.62 0.93 -0.67 0.00 0.00 178.83 180.67 2efi h GLU 89 N -0.04 1.11 0.19 1.46 4.39 -1.93 -0.62 114.58 119.14 2efi h GLU 89 Ca 0.04 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2efi h GLU 89 Cb 0.32 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2efi h GLU 89 CO 0.00 0.73 -0.09 1.96 -1.16 0.00 0.00 179.01 180.46 2efi h GLN 90 N 1.14 -0.24 -0.36 2.33 4.20 -1.94 -2.48 115.11 117.76 2efi h GLN 90 Ca 0.41 0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.16 2efi h GLN 90 Cb 0.13 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2efi h GLN 90 CO -0.16 -0.08 0.17 -0.92 -0.67 0.00 0.00 178.83 177.17 2efi h TYR 91 N -0.35 0.31 -0.94 2.96 3.20 -1.05 -2.22 116.97 118.88 2efi h TYR 91 Ca -0.03 0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.03 2efi h TYR 91 Cb 0.27 -0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.35 2efi h TYR 91 CO -0.03 0.16 0.54 0.00 -1.64 0.00 0.00 178.16 177.19 2efi h ALA 92 N 1.19 1.49 -0.58 1.82 0.00 -1.03 -3.42 119.26 118.73 2efi h ALA 92 Ca 0.15 0.08 -0.78 0.00 0.00 0.00 0.00 54.91 54.36 2efi h ALA 92 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2efi h ALA 92 CO -0.11 -0.05 1.12 -1.91 0.00 0.00 0.00 179.25 178.30 2efi n GLU 93 N -4.81 0.27 0.00 0.00 0.00 -0.84 0.11 120.64 115.37 2efi n GLU 93 Ca 0.20 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.45 2efi n GLU 93 Cb 0.50 -1.70 0.00 0.00 0.00 0.00 0.00 31.44 30.25 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2efi n GLY 94 N 6.09 3.09 3.73 8.31 0.00 -1.26 -5.05 105.19 120.10 2efi n GLY 94 Ca 0.44 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2efi n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2efi s LYS 95 N 0.00 4.30 0.18 1.61 1.02 0.12 -5.01 119.74 121.95 2efi s LYS 95 Ca 0.00 2.20 -0.04 0.00 0.02 0.00 0.00 55.97 58.15 2efi s LYS 95 Cb 0.00 -3.17 -0.05 0.00 -0.52 0.00 0.00 37.83 34.09 2efi s LYS 95 CO 0.00 -0.42 0.41 0.00 -0.92 0.00 0.00 175.35 174.42 2efi s MET 96 N 0.31 3.60 -0.46 1.68 0.23 -1.26 -5.00 119.30 118.40 2efi s MET 96 Ca 0.62 -0.13 -0.26 0.00 -1.03 0.00 0.00 55.69 54.89 2efi s MET 96 Cb -0.40 -2.81 -0.06 0.00 -1.53 0.00 0.00 34.83 30.03 2efi s MET 96 CO 0.37 0.41 2.33 0.50 -2.03 0.00 0.00 175.02 176.60 2efi s ARG 97 N -2.95 2.29 0.05 3.16 3.52 -1.26 -4.31 118.95 119.46 2efi s ARG 97 Ca 0.41 1.43 0.00 0.00 -0.13 0.00 0.00 55.73 57.44 2efi s ARG 97 Cb -0.12 -4.54 0.00 0.00 -1.56 0.00 0.00 34.95 28.74 2efi s ARG 97 CO 0.26 -3.06 0.00 0.41 -0.81 0.00 0.00 175.30 172.10 2efi n GLY 98 N 5.94 -0.72 2.71 8.12 0.00 -1.26 -5.05 105.19 114.93 2efi n GLY 98 Ca 0.34 0.10 -0.28 0.00 0.00 0.00 0.00 46.02 46.18 2efi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2efi s ALA 99 N -2.00 2.67 -0.65 4.61 0.00 -1.26 -5.33 121.76 119.80 2efi s ALA 99 Ca 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 51.96 48.87 2efi s ALA 99 Cb 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.19 2efi s ALA 99 CO 0.00 -2.05 0.16 0.00 0.00 0.00 0.00 175.76 173.87